339278-05-6
Product Name:
2-[[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL](METHYL)AMINO]-4-NITRO-1H-ISOINDOLE-1,3(2H)-DIONE
Formula:
C15H8ClF3N4O4
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COMPUTED DESCRIPTORS
Molecular Weight | 400.69 g/mol |
---|---|
XLogP3 | 3.5 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 9 |
Rotatable Bond Count | 2 |
Exact Mass | 400.0186169 g/mol |
Monoisotopic Mass | 400.0186169 g/mol |
Topological Polar Surface Area | 99.3 Ų |
Heavy Atom Count | 27 |
Formal Charge | 0 |
Complexity | 644 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |